SCHEMBL8961492

SCHEMBL8961492

CC(Oc1ccccc1Cn1cnc2c(=O)[nH]c(N)nc21)C(F)(F)P(=O)(O)O

nearest known ligand 0.70

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PNP P00491 18/20 0.70
HPRT1 P00492 2/20 0.49

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL8955603 0.82 PNP (1.00) PNPHPRT1
SCHEMBL8955850 0.82 PNP (0.83) PNPHPRT1
SCHEMBL8955178 0.82 PNP (1.00) PNP
SCHEMBL8955206 0.80 PNP (1.00) PNP
SCHEMBL10507619 0.79 PNP (0.72) PNP
SCHEMBL8955967 0.78 PNP (0.72) PNP
SCHEMBL8955531 0.77 PNP (0.70) PNP
SCHEMBL1938289 0.76 PNP (0.73) PNP
SCHEMBL8961586 0.75 PNP (0.65) PNP
SCHEMBL8955854 0.75 PNP (0.67) PNPHPRT1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0465297-B1 9-Purinyl phosphonic acid derivatives MERRELL DOW PHARMA (US) 1996-01-31 EP disclosed